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1-[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]hexadec-2-yn-1-one

1-[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]hexadec-2-yn-1-one

Systemtic Name:1-[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]hexadec-2-yn-1-one
Openeye Name:1-[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]hexadec-2-yn-1-one
CAS Name:1-[(2S)-1-[(1R)-1-phenylethyl]-2-aziridinyl]-2-hexadecyn-1-one
IUPAC Name:1-[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]hexadec-2-yn-1-one
Traditional Name:1-[(2S)-1-[(1R)-1-phenylethyl]ethylenimin-2-yl]hexadec-2-yn-1-one
Formula: C26H39NO
MolecularWeight: 381.59396
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC#CC(=O)C1CN1C(C)C2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCCCCCC#CC(=O)[C@@H]1CN1[C@H](C)C2=CC=CC=C2


InChI

InChI=1S/C26H39NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-21-26(28)25-22-27(25)23(2)24-19-16-15-17-20-24/h15-17,19-20,23,25H,3-14,22H2,1-2H3/t23-,25+,27?/m1/s1


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